N,N'-bis[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]octanediamide dibromide

Systemtic Name: N,N'-bis[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]octanediamide dibromide Openeye Name: N,N'-bis[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]octanediamide dibromide CAS Name: N,N'-bis[4-[(1-methyl-4-pyridin-1-iumyl)amino]phenyl]octanediamide dibromide IUPAC Name: N,N'-bis[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]octanediamide dibromide Traditional Name: N,N'-bis[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]suberamide dibromide Formula: C32H38Br2N6O2 MolecularWeight: 698.49112

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)CCCCCCC(=O)NC3=CC=C(C=C3)NC4=CC=[N+](C=C4)C.[Br-].[Br-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)CCCCCCC(=O)NC3=CC=C(C=C3)NC4=CC=[N+](C=C4)C.[Br-].[Br-]

InChI

InChI=1S/C32H36N6O2.2BrH/c1-37-21-17-29(18-22-37)33-25-9-13-27(14-10-25)35-31(39)7-5-3-4-6-8-32(40)36-28-15-11-26(12-16-28)34-30-19-23-38(2)24-20-30;;/h9-24H,3-8H2,1-2H3,(H2,35,36,39,40);2*1H